tert-butyl 3-[[2-[3-(3-methoxyphenyl)propyl]phenoxy]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[2-[3-(3-methoxyphenyl)propyl]phenoxy]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[2-[3-(3-methoxyphenyl)propyl]phenoxy]methyl]piperidine-1-carboxylate CAS Name: 3-[[2-[3-(3-methoxyphenyl)propyl]phenoxy]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[2-[3-(3-methoxyphenyl)propyl]phenoxy]methyl]piperidine-1-carboxylate Traditional Name: 3-[[2-[3-(3-methoxyphenyl)propyl]phenoxy]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C27H37NO4 MolecularWeight: 439.58698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)COC2=CC=CC=C2CCCC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)COC2=CC=CC=C2CCCC3=CC(=CC=C3)OC

InChI

InChI=1S/C27H37NO4/c1-27(2,3)32-26(29)28-17-9-12-22(19-28)20-31-25-16-6-5-13-23(25)14-7-10-21-11-8-15-24(18-21)30-4/h5-6,8,11,13,15-16,18,22H,7,9-10,12,14,17,19-20H2,1-4H3